Spectrum MetaboBASE0595 for 5,3',4'-Trihydroxyflavone

Rating: (*)(*)(*)(*)( )

Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
KXPQYWKYYDYOCQ-UHFFFAOYSA-N
C15H10O5
270.05282342
O=C1C=C(OC=2C=CC=C(O)C12)C=3C=CC(O)=C(O)C3
InChI=1S/C15H10O5/c16-9-5-4-8(6-11(9)18)14-7-12(19)15-10(17)2-1-3-13(15)20-14/h1-7,16-18H

Mass Spectral Metadata

NameValue
License CC-BY-NC-SA 4.0 International
Plant Biology, The Noble Foundation, Ardmore, OK, US/Dennis Fine, Daniel Wherritt, and Lloyd Sumner
LC-ESI-TOF
impact HD
ESI
negative
Nitrogen
0.01
2013-11-23 11:35:50+01:00
Waters Acquity BEH C18 1.7um x 2.1 x 150 mm
705.6
C:\Data\Confirmed Standards\Confirmed stds MSMS 22Nov13\53'4'-Trihydroxyflavone MSMS.d
0.6923275378907373
0.35578597409898066